
C7H11N3O6S.H2O.Na
2938989-90-1 Copyright (C) 2024 ACS
 20 19  0  0  0  0  0  0  0  0999 V2000
    0.9417    5.3726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.5912    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3571    3.9478    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9779    6.5197    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0229    4.7189    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7929    6.0525    0.0000 S   0  0  0  0  0  6  0  0  0  0  0  0
    9.5629    7.3861    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1267    5.2825    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4593    6.8225    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7819    4.4109    0.0000 N   0  0  1  0  0  0  0  0  0  0  0  0
    2.4678    5.5787    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.1359    4.9879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9998    3.0800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3219    6.8947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4829    4.7189    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8464    4.3919    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.4923    5.6361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7126    3.1187    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0634    1.5400    0.0000 Na  0  0  0  0  0 15  0  0  0  0  0  0
    5.0634    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
 11  1  1  6  0  0  0
  4 12  2  0  0  0  0
  5  6  1  0  0  0  0
  5 15  1  0  0  0  0
  6  7  2  0  0  0  0
  6  8  2  0  0  0  0
  6  9  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  6  0  0  0
 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
 12 15  1  0  0  0  0
 13 16  1  0  0  0  0
 14 17  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  6  0  0  0
M  END
> <cas.rn>
2938989-90-1

> <cas.index.name>
Not Yet Assigned

> <molecular.formula>
C7H11N3O6S.H2O.Na

> <molecular.weight>
306.25

$$$$
